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1426246-59-4

1426246-59-4 | (3-Chloro-4-morpholinophenyl);boronic acid

CAS No: 1426246-59-4 Catalog No: AG003J8O MDL No:MFCD16660219

Product Description

Catalog Number:
AG003J8O
Chemical Name:
(3-Chloro-4-morpholinophenyl);boronic acid
CAS Number:
1426246-59-4
Molecular Formula:
C10H13BClNO3
Molecular Weight:
241.4791
MDL Number:
MFCD16660219
IUPAC Name:
(3-chloro-4-morpholin-4-ylphenyl)boronic acid
InChI:
InChI=1S/C10H13BClNO3/c12-9-7-8(11(14)15)1-2-10(9)13-3-5-16-6-4-13/h1-2,7,14-15H,3-6H2
InChI Key:
MLYNSBCEZWQQEF-UHFFFAOYSA-N
SMILES:
Clc1cc(ccc1N1CCOCC1)B(O)O

Properties

Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.068g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
241.478g/mol
Monoisotopic Mass:
241.068g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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